UCSF

ZINC06951140

Substance Information

In ZINC since Heavy atoms Benign functionality
May 3rd, 2006 20 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.68 3.7 -15.86 2 8 0 120 276.252 3
Mid Mid (pH 6-8) 2.14 1.94 -36.61 1 8 -1 123 275.244 3

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )